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4-Heptynylbromobenzene
SpectraBase Compound ID Kv1lmph1NL5
InChI InChI=1S/C13H15Br/c1-2-3-4-5-6-7-12-8-10-13(14)11-9-12/h8-11H,2-5H2,1H3
InChIKey CWXPKGZBLFJCMY-UHFFFAOYSA-N
Mol Weight 251.17 g/mol
Molecular Formula C13H15Br
Exact Mass 250.035713 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kSRSKL7kiy
Name 4-Heptynylbromobenzene
Alternate Name(s) 1-bromo-2-(4-heptynyl)benzene 1-bromo-4-hept-1-ynylbenzene 1-bromanyl-4-hept-1-ynyl-benzene
Comments Less than 3 mono-isotopic peaks
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Formula C13H15Br
InChI InChI=1S/C13H15Br/c1-2-3-4-5-6-7-12-8-10-13(14)11-9-12/h8-11H,2-5H2,1H3
InChIKey CWXPKGZBLFJCMY-UHFFFAOYSA-N
Molecular Weight 251.167 g/mol
SMILES C(#CCCCCC)c1ccc(cc1)Br
SPLASH splash10-0gb9-0950000000-c68e7bf131cc0b36d2df
Source of Spectrum J-63-8923-4
Wiley ID 1253125